Geometry & MOs

Info

ID:

231756

PubChem CID:

87574607

Reduced:

NO5C7H14 (1)

Stoich.:

AB5C7D14 (1)

Weight, g/mol:

176.092283

ΔHf, kcal/mol:

-203.31

Dipole, Da:

10.62

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.754532

Charge, e:

 1

Chem-info

IUPAC name:

trimethyl(2-oxalooxyethyl)azanium

Drug info:

PubChemData

Smile

C[N+](C)(C)CCO.C(=O)(C(=O)[O-])[O-]

DOS

IR

Vibrations